N-[[6-(3,5-dimethylpyrazol-1-yl)pyridin-3-yl]methyl]-2-methylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[[6-(3,5-dimethylpyrazol-1-yl)pyridin-3-yl]methyl]-2-methylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[[6-(3,5-dimethylpyrazol-1-yl)-3-pyridyl]methyl]-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: N-[[6-(3,5-dimethyl-1-pyrazolyl)-3-pyridinyl]methyl]-2-(methylthio)-3-pyridinecarboxamide IUPAC Name: N-[[6-(3,5-dimethylpyrazol-1-yl)pyridin-3-yl]methyl]-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-[[6-(3,5-dimethylpyrazol-1-yl)-3-pyridyl]methyl]-2-(methylthio)nicotinamide Formula: C18H19N5OS MolecularWeight: 353.44136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NC=C(C=C2)CNC(=O)C3=C(N=CC=C3)SC)C

Isomeric SMILES

CC1=CC(=NN1C2=NC=C(C=C2)CNC(=O)C3=C(N=CC=C3)SC)C

InChI

InChI=1S/C18H19N5OS/c1-12-9-13(2)23(22-12)16-7-6-14(10-20-16)11-21-17(24)15-5-4-8-19-18(15)25-3/h4-10H,11H2,1-3H3,(H,21,24)